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CAS Number: 21917-86-2
7,8-dihydroisoquinolin-5(6H)-one

Structure

7,8-dihydroisoquinolin-5(6H)-one
Name: 7,8-dihydroisoquinolin-5(6H)-one
Synonyms:
General Information
Product Number: 21917862

CAS Registry Number 21917-86-2
Name:
5(6H)​-​Isoquinolinone, 7,​8-​dihydro-
5(6H)-Isoquinolone, 7,8-dihydro- (6CI,8CI)
7,8-Dihydro-6H-isoquinolin-5-one
7,8-Dihydroisoquinolin-5(6H)-one

 

Chemical Formula: C9H9NO
Exact Mass: 147.07
Molecular Weight: 147.17
m/z: 147.07 (100.0%), 148.07 (10.2%)

 

InChI:InChI=1S/C9H9NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h4-6H,1-3H2

InChI Key:AGSMKBYNAKIVTB-UHFFFAOYSA-N

Canonical SMILES:C1CC2=C(C=CN=C2)C(=O)C1

 

Thermal Properties Value Condition Note
Boiling Point 113-115 °C Press: 4 Torr (1)CAS

Specification

98%

References
  1. (1) Sugimoto, Norio; Yakugaku Zasshi 1956, V76, P1308-10 CAPLUS
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